D092-0083F Screening compound: N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido]acetamide

D092-0083F Screening compound: N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido]acetamide
D092-0083F Screening compound: N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D092-0083F
N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido]acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

D092-0083F

Molecular Formula

C27H30N6O3 (C27 H30 N6 O3)

Compound Name

N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1,2,3,4-tetrazol-2-yl]acetamido]acetamide

IUPAC name

N-tert-butyl-2-(furan-2-yl)-2-[N-(2-methylphenyl)-2-[5-(4-methylphenyl)-2H-1234-tetrazol-2-yl]acetamido]acetamide

SMILES

CC(C)(C)NC(C(c1ccco1)N(C(Cn1nnc(-c2ccc(C)cc2)n1)=O)c1c(C)cccc1)=O

InChI

InChI=1S/C27H30N6O3/c1-18-12-14-20(15-13-18)25-29-31-32(30-25)17-23(34)33(21-10-7-6-9-19(21)2)24(22-11-8-16-36-22)26(35)28-27(3,4)5/h6-16,24H,17H2,1-5H3,(H,28,35)/t24-/m1/s1

InChI Key

SCCIQKOEBYFOKQ-XMMPIXPASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.809

Distribution Coefficient, logD

4.809

Water Solubility, LogSw

-4.54

Polar Surface Area

84.315

Acid Dissociation Constant (pKa)

14.57

Base Dissociation Constant (pKb)

4.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with D092-0083F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D092-0083F?
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What is the minimum amount of D092-0083F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D092-0083F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D092-0083F
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of D092-0083F available by request